SCHEMBL4860352

SCHEMBL4860352

O=C(O)Oc1ccccc1-c1ccccc1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.50
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
FFAR4 Q5NUL3 2/20 0.48
PTGS2 P35354 1/20 0.46
HTT P42858 1/20 0.46
BRD4 O60885 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
TSPO P30536 1/20 0.45
SLC9A1 P19634 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
TSHR P16473 1/20 0.44
AKR1C3 P42330 1/20 0.43
ADRA2C P18825 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4860339 0.89 CTNNB1 (0.50) CTNNB1LMNAGAAKMT2AFFAR4
SCHEMBL7017642 0.88 FABP3 (0.44) LMNAGAAKMT2APTGS2SMN1; SMN2
SCHEMBL571709 0.86 CTNNB1 (0.55) CTNNB1LMNAGAAKMT2AHTT
SCHEMBL236810 0.84 FFAR4 (0.55) CTNNB1LMNAFFAR4PTGS2HTT
SCHEMBL31506496 0.84 FFAR4 (0.55) CTNNB1LMNAFFAR4PTGS2HTT
SCHEMBL2203391 0.83 TSHR (0.58) CTNNB1LMNAGAAKMT2AFFAR4
SCHEMBL6406032 0.81 NCOA1 (0.55) CTNNB1LMNAGAAKMT2AFFAR4
SCHEMBL11833811 0.79 NCOA1 (0.53) CTNNB1LMNAGAAKMT2AFFAR4
SCHEMBL8765509 0.78 ALDH1A1 (0.53) LMNAKMT2AHTTSMN1; SMN2AKR1C3
SCHEMBL3309694 0.78 FABP7 (0.56) GAAKMT2ASMN1; SMN2TSHRADRA2C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7345133-B2 Branched polycarbonates BAYER MATERIALSCIENCE AG (DE) 2008-03-18 US disclosed
US-20060094855-A1 Branched polycarbonates BAYER MATERIALSCIENCE AG 2006-05-04 US disclosed